openmolecules.org Forum: Cheminformatics

Home » DataWarrior » Cheminformatics » Drug score

Show: Today's Messages :: Polls :: Message Navigator

Re: Drug score [message #1103 is a reply to message #183]

Thu, 29 October 2020 14:56

Sifontes
Messages: 1
Registered: October 2020
Location: Cuba

Junior Member

Dear Thomas,
I installed the macro successfully and performed some test calculations. It worked fantasticly. So far, I had run the calculations in a dedicated excel spreadsheet. Thanks for that new contribution!!!
However, I have a doubt. In the formula for the calculation of the drug score, the coefficients for drugability are 1 and 0. That results in and inversely proportional contribution of druglikeness to the drug score, ie. the higher the druglikeness, the lower the drug score. Please, correct me if I´m wrong.
Best wishes,
Sergio

Report message to a moderator

[Message index]

		Drug score By: plonacyrydwan on Thu, 15 January 2015 00:14
		Re: Drug score By: thomas on Thu, 29 January 2015 21:10
		Re: Drug score By: dalafave on Fri, 17 June 2016 02:07
		Re: Drug score By: thomas on Sun, 19 June 2016 21:18
		Re: Drug score By: Sifontes on Thu, 29 October 2020 14:56
		Re: Drug score By: thomas on Thu, 05 November 2020 13:29

Previous Topic:	translation of the idcodes
Next Topic:	Bring particular data forward in a graph

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Mon Aug 18 13:47:23 CEST 2025

Total time taken to generate the page: 0.05500 seconds